Crystallography Open Database

Information card for entry 8102680

Preview

Coordinates	8102680.cif

Structure parameters

Chemical name	bis(1,3-bis(benzimidazol-2-yl)benzene)- dichlorinecadmium, Cd(H~2~bbb)~2~Cl~2~
Formula	C40 H28 Cd Cl2 N8
Calculated formula	C40 H28 Cd Cl2 N8
Title of publication	Crystal structure of bis[1,3-bis(benzimidazol-2-yl)benzene]dichlorocadmium(II), Cd(C20H14N4)2Cl2
Authors of publication	Bing-Li Jiang; Fa-Yan Meng; Li Wang; Cui-Wu Lin
Journal of publication	Zeitschrift für Kristallographie - New Crystal Structures
Year of publication	2010
Journal volume	225
Journal issue	2
Pages of publication	313
a	20.8803 ± 0.0005 Å
b	9.463 ± 0.0002 Å
c	18.2008 ± 0.0003 Å
α	90°
β	109.201 ± 0.001°
γ	90°
Cell volume	3396.24 ± 0.12 Å³
Cell temperature	153 ± 2 K
Ambient diffraction temperature	153 ± 2 K
Number of distinct elements	5
Space group number	15
Hermann-Mauguin space group symbol	C 1 2/c 1
Hall space group symbol	-C 2yc
Residual factor for all reflections	0.0232
Residual factor for significantly intense reflections	0.0202
Weighted residual factors for significantly intense reflections	0.0511
Weighted residual factors for all reflections included in the refinement	0.0617
Goodness-of-fit parameter for all reflections included in the refinement	1.08
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

Version history

Revision	Date	Message	Files
176432 (current)	2016-02-14	cif/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries.	8102680.cif
35911	2012-02-28	cif/ Reorganising ranges 1, 3, 5, 6 and 8 into a prefix-directory tree.	8102680.cif
13419	2011-03-06	../uploads/cif-deposit/cod/cif Adding structures of 8102680 via cif-deposit CGI script.	8102680.cif